N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide

C16H24N4O2 — CID 86986680

IUPACN-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide
SMILESCCNC(=O)CNC(=O)Nc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C16H24N4O2/c1-2-17-15(21)12-18-16(22)19-13-6-8-14(9-7-13)20-10-4-3-5-11-20/h6-9H,2-5,10-12H2,1H3,(H,17,21)(H2,18,19,22)
InChIKeyJEIYVIAAHHIHPZ-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.93
Rot. Bonds5

About N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide

N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide (PubChem CID 86986680) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide
PubChem CID86986680
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide
SMILESCCNC(=O)CNC(=O)Nc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C16H24N4O2/c1-2-17-15(21)12-18-16(22)19-13-6-8-14(9-7-13)20-10-4-3-5-11-20/h6-9H,2-5,10-12H2,1H3,(H,17,21)(H2,18,19,22)
InChIKeyJEIYVIAAHHIHPZ-UHFFFAOYSA-N
XLogP1.93
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-3-(4-piperidin-1-ylphenyl)urea
CID 108890460
N-[4-(azepan-1-yl)phenyl]-2-[(4-methoxyphenyl)carbamoylamino]acetamide
CID 17463645
(E)-3-[4-(azepan-1-yl)phenyl]-N-[2-(ethylamino)-2-oxoethyl]prop-2-enamide
CID 9224931
N-ethyl-2-[(4-piperidin-1-ylphenyl)methylamino]acetamide
CID 43398950
1-(2-ethyl-2-hydroxybutyl)-3-(4-piperidin-1-ylphenyl)urea
CID 111103418
N-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]butanamide
CID 113000164
N-ethyl-2-[(4-pyrrolidin-1-ylphenyl)methylamino]acetamide
CID 43777709
N-[4-(azepan-1-yl)phenyl]butanamide
CID 60593025
1-(cyclohexylmethyl)-3-(4-piperidin-1-ylphenyl)urea
CID 108902937
2-methyl-3-[(4-pyrrolidin-1-ylphenyl)carbamoylamino]propanoic acid
CID 63179912
N-[4-(4-pyrrolidin-1-ylanilino)phenyl]propanamide
CID 112988748
N-(4-piperidin-1-ylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78908637

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide?
The IUPAC name of N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide (CID 86986680) is N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide?
The canonical SMILES for N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide is CCNC(=O)CNC(=O)Nc1ccc(N2CCCCC2)cc1.
What is the InChIKey of N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide?
The InChIKey is JEIYVIAAHHIHPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-2-17-15(21)12-18-16(22)19-13-6-8-14(9-7-13)20-10-4-3-5-11-20/h6-9H,2-5,10-12H2,1H3,(H,17,21)(H2,18,19,22).
What are the key properties of N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide?
N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide has a molecular weight of 304.39 g/mol, XLogP of 1.93, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(4-piperidin-1-ylphenyl)carbamoylamino]acetamide is sourced from PubChem (CID 86986680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).